(1R,5S)-N-(3-fluorophenyl)-7-[4-(5-pyrimidinyl)phenyl]-3,6-diazabicyclo[3.1.1]heptane-3-carboxamide

Properties Image MNX_ID MNXM169796 reference chebi:125111 formula C22H20FN5O global charge 0 mol weight 389.434 InChIKey LDBAZNWOVYQXEL-WCRBZPEASA-N InChI InChI=1S/C22H20FN5O/c23-17-2-1-3-18(8-17)26-22(29)28-11-19-21(20(12-28)27-19)15-6-4-14(5-7-15)16-9-24-13-25-10-16/h1-10,13,19-21,27H,11-12H2,(H,26,29)/t19-,20+,21? SMILES O=C(NC1=CC(F)=CC=C1)N1C[C@@H]2N[C@H](C1)C2C1=CC=C(C2=CN=CN=C2)C=C1 MNX internals InChI (mnx) InChI=1/C22H20FN5O/c23-17-2-1-3-18(8-17)26-22(29)28-11-19-21(20(12-28)27-19)15-6-4-14(5-7-15)16-9-24-13-25-10-16/h1-10,13,19-21,27H,11-12H2,(H,26,29)/t19-,20+,21? SMILES (mnx) [CH:1]1=[CH:2][C:17]([F:23])=[CH:8][C:18]([N:26]=[C:22]([N:28]2[CH2:11][C@H:19]3[CH:21]([C:15]4=[CH:7][CH:5]=[C:14]([C:16]5=[CH:9][N:24]=[CH:13][N:25]=[CH:10]5)[CH:4]=[CH:6]4)[C@@H:20]([CH2:12]2)[NH:27]3)[OH:29])=[CH:3]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0